Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | CA12 | O43570 | 7/20 | 0.49 |
| ▸ | CA1 | P00915 | 7/20 | 0.49 |
| ▸ | CA2 | P00918 | 7/20 | 0.49 |
| ▸ | CA9 | Q16790 | 7/20 | 0.49 |
| ▸ | CA3 | P07451 | 4/20 | 0.47 |
| ▸ | CA4 | P22748 | 4/20 | 0.47 |
| ▸ | CA6 | P23280 | 4/20 | 0.47 |
| ▸ | CA5A | P35218 | 4/20 | 0.47 |
| ▸ | CA7 | P43166 | 4/20 | 0.47 |
| ▸ | CA13 | Q8N1Q1 | 4/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.47 |
| ▸ | CA5B | Q9Y2D0 | 4/20 | 0.47 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL31704535 | 0.87 | MAPT (0.51) | MAPTNPSR1CA12CA1CA2 | |
| SCHEMBL6922302 | 0.87 | MAPT (0.45) | MAPTNPSR1HTT | |
| SCHEMBL8574362 | 0.85 | GAA (0.56) | MAPTNPSR1ALDH1A1HTT | |
| SCHEMBL8573433 | 0.85 | ABL1 (0.51) | MAPTNPSR1ALDH1A1TSHRATM | |
| SCHEMBL1110766 | 0.85 | MAPT (0.45) | MAPTNPSR1CA12CA1CA2 | |
| SCHEMBL15177548 | 0.85 | CA1 (0.67) | CA12CA1CA2CA9CA3 | |
| SCHEMBL8573173 | 0.84 | TSHR (0.44) | MAPTNPSR1CA12CA1CA2 | |
| SCHEMBL1111021 | 0.83 | TSHR (0.43) | MAPTNPSR1CA12CA1CA2 | |
| SCHEMBL8574698 | 0.82 | HTT (0.40) | MAPTNPSR1CA12CA1CA2 | |
| SCHEMBL8576682 | 0.82 | MAPT (0.39) | MAPTNPSR1CA12CA1CA2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5849796-A | Ortho-substituted benzoil acid derivatives | MERCK PATENT GELSELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-12-15 | — | — | US | disclosed |